(1S,11R,13S,14S,15S)-14,15-Dimethoxy-20-Methyl-5,7,21-Trioxa-20-Azahexacyclo[11.4.3.1~11,14~.0~1,13~.0~2,10~.0~4,8~]Henicosa-2(10),3,8-Trien-16-One

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Properties Simple | Detailed

Formula C20H25NO6
IUPAC Name methyl (2s)-2-methoxy-4-[(4s)-1-methyl-4-(6-vinyl-1,3-benzodioxol-5-yl)-2,3-dihydropyrrol-4-yl]-3-oxo-butanoate
Molecular Mass 375.416 g·mol−1
Heat of Formation -594.2 ± 16.7 kJ·mol−1
Dipole Moment 1.71 ± 1.08 D
Volume 440.28 Å 3
Surface Area 347.92 Å 2
HOMO Energy -8.63 ± 0.55 eV
LUMO Energy 3.00 ± eV
Point Group Symmetry C1
InChIKey QJDYNQYLCIPODD-JAZQRGJZSA-N
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